Package | Description |
---|---|
org.openscience.cdk.isomorphism | |
org.openscience.cdk.layout | |
org.openscience.cdk.smarts |
Class and Description |
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AtomMatcher
Defines compatibility checking of atoms for (subgraph)-isomorphism mapping.
|
BondMatcher
Defines compatibility checking of bonds for (subgraph)-isomorphism mapping.
|
DfPattern
The depth-first (DF) backtracking sub-structure matching algorithm so named
because it matches the molecule in a depth-first manner (bond by bond).
|
Mappings
A fluent interface for handling (sub)-graph mappings from a query to a target
structure.
|
Pattern
A structural pattern for finding an exact matching in a target compound.
|
Class and Description |
---|
Pattern
A structural pattern for finding an exact matching in a target compound.
|
Class and Description |
---|
Mappings
A fluent interface for handling (sub)-graph mappings from a query to a target
structure.
|
Pattern
A structural pattern for finding an exact matching in a target compound.
|
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